N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-(2-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-[2-(2-methoxyphenyl)-2-pyrrolidino-ethyl]-2-(3-pyridyl)cinchoninamide Formula: C28H28N4O2 MolecularWeight: 452.54752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4)N5CCCC5

Isomeric SMILES

COC1=CC=CC=C1C(CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4)N5CCCC5

InChI

InChI=1S/C28H28N4O2/c1-34-27-13-5-3-11-22(27)26(32-15-6-7-16-32)19-30-28(33)23-17-25(20-9-8-14-29-18-20)31-24-12-4-2-10-21(23)24/h2-5,8-14,17-18,26H,6-7,15-16,19H2,1H3,(H,30,33)